4-[(3-methylphenyl)methylsulfanyl]-1-propyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one

Systemtic Name: 4-[(3-methylphenyl)methylsulfanyl]-1-propyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one Openeye Name: 4-(m-tolylmethylsulfanyl)-1-propyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one CAS Name: 4-[(3-methylphenyl)methylthio]-1-propyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one IUPAC Name: 4-[(3-methylphenyl)methylsulfanyl]-1-propyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one Traditional Name: 4-[(3-methylbenzyl)thio]-1-propyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one Formula: C18H22N2OS MolecularWeight: 314.44508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(CCC2)C(=NC1=O)SCC3=CC=CC(=C3)C

Isomeric SMILES

CCCN1C2=C(CCC2)C(=NC1=O)SCC3=CC=CC(=C3)C

InChI

InChI=1S/C18H22N2OS/c1-3-10-20-16-9-5-8-15(16)17(19-18(20)21)22-12-14-7-4-6-13(2)11-14/h4,6-7,11H,3,5,8-10,12H2,1-2H3